Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.41 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.41 |
| ▸ | LIPE | Q05469 | 1/20 | 0.41 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.40 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | F2R | P25116 | 1/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL640841 | 0.79 | F2R (0.48) | HRH3ALDH1A1NPC1RAB9AS1PR1 | |
| SCHEMBL31435474 | 0.76 | AKR1C3 (0.57) | ALDH1A1NPC1HPGDRAB9AAKR1C3 | |
| SCHEMBL12719985 | 0.76 | S1PR5 (0.41) | HRH3RAB9APOLBS1PR1S1PR5 | |
| SCHEMBL23932469 | 0.70 | AKR1C3 (0.57) | NPC1RAB9AAKR1C3AKR1C1 | |
| SCHEMBL156662 | 0.70 | RORC (0.51) | AKR1C3AKR1C1USP30 | |
| SCHEMBL27266752 | 0.70 | AKR1C3 (0.47) | ALDH1A1AKR1C3AKR1C1POLBUSP30 | |
| SCHEMBL924621 | 0.70 | GRIN2B (0.61) | ALDH1A1NPC1AKR1C3AKR1C1 | |
| SCHEMBL662123 | 0.70 | F2R (0.69) | NPC1HPGDRAB9AFAAHPOLB | |
| SCHEMBL4966951 | 0.70 | RAB9A (0.48) | HRH3ALDH1A1NPC1CYP3A4CYP2D6 | |
| SCHEMBL3723289 | 0.68 | F2R (0.46) | ALDH1A1AKR1C3AKR1C1POLBS1PR1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1954693-A1 | BETA-SECRETASE MODULATORS AND METHODS OF USE | Amgen Inc. (US) | 2008-08-13 | — | — | EP | disclosed |
| WO-2007062007-A1 | BETA-SECRETASE MODULATORS AND METHODS OF USE | AMGEN INC. (US) | 2007-05-31 | — | — | WO | disclosed |